NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 31 L 4.3071 8.0276 122.4905 55.0606 44.3450 178.6710 32 E 3.8109 8.0607 116.8698 58.5821 29.2469 175.4750 33 E 4.0923 8.3633 119.3093 58.4309 29.8593 179.7799 34 Q 3.9648 8.1830 120.6076 58.7419 29.3757 177.0344 35 L 3.9210 7.9659 120.8703 58.6504 41.6552 178.6451 36 N 4.3666 8.0806 115.6654 56.1761 38.4222 177.3603 37 K 3.9856 7.6259 120.5826 59.4164 32.2069 179.0829 38 S 4.0408 8.1478 115.7258 61.4450 62.8814 176.0418 39 L 3.9668 7.9912 122.9472 58.6820 41.6011 179.2544 40 K 4.0034 7.8689 118.0881 59.3230 32.0509 178.9945 41 T 3.8804 7.9540 115.6998 67.0623 68.5396 176.4759 42 I 3.6512 8.3703 121.1031 64.5775 37.2584 178.2582 43 A 4.0010 8.1132 121.3850 55.4976 17.9301 179.8460 44 S 4.0635 8.2027 113.6631 61.8855 62.8576 176.6069 45 Q 3.5335 8.7786 121.0724 58.8767 28.4252 179.7267 46 K 3.7960 8.1525 120.4532 59.3650 32.3594 178.7021 47 A 3.9595 8.0919 120.7411 55.1968 18.1535 179.2553 48 A 4.0323 8.5308 118.8884 54.9564 18.6406 178.9214 49 I 4.2555 7.1119 116.9867 62.3316 38.4439 177.6042 50 E 3.9921 8.5106 120.9583 59.4191 29.5202 178.5825 51 N 4.4622 8.7037 116.8602 55.9519 38.5797 176.9785 52 Y 3.9238 7.8802 120.8491 60.6224 39.1832 177.1404 53 N 4.4138 8.1850 117.2226 56.4665 38.5890 177.2749 54 Q 4.0215 8.0183 118.8564 59.2014 28.4090 178.6029 55 L 3.9331 7.7363 121.5829 57.7400 42.4155 178.6147 56 K 3.8232 8.2139 119.0558 58.1813 31.9385 178.1386 57 E 3.9450 7.9175 119.3386 60.0853 29.3161 178.1131 58 D 4.3902 7.8345 118.8822 57.1885 40.6773 178.3618 59 Y 3.9908 8.1471 120.4431 60.9152 38.7432 177.7273 60 N 4.5584 8.3832 116.6576 55.9698 38.2520 177.3242 61 T 4.0145 8.1009 117.3273 65.4937 68.5369 176.6590 62 L 3.9483 7.3183 120.0197 56.9531 41.5931 178.4557 63 K 3.6490 7.9813 120.3196 59.8570 31.9589 178.7549 64 R 3.9929 7.7071 115.7845 59.2428 29.2874 178.4514 65 E 4.9113 7.6270 120.0853 58.1399 29.4150 178.8551 66 L 3.9509 8.4163 121.3249 57.7811 42.1711 178.7904 67 S 4.0496 7.7126 112.3468 61.5946 62.0281 175.8393 68 D 4.3856 7.9175 121.1067 57.2832 40.5965 178.7255 69 R 3.9589 7.7000 117.8198 58.1505 30.3449 178.3448 70 D 4.4560 8.4634 118.8761 56.4406 40.8385 177.6185 71 D 4.4258 7.9938 118.1872 55.9812 41.3340 177.9601 72 E 3.8798 7.5869 119.9769 59.3488 29.5869 178.4205 73 V 3.5533 7.7153 118.0120 66.5729 31.5382 177.4489 74 K 3.6935 8.0095 116.4526 60.0871 31.9888 178.8405 75 R 4.1242 8.3348 117.3974 59.8037 29.9110 179.0616 76 L 3.9544 8.0494 118.2347 58.0802 41.4144 179.7775 77 R 3.9607 8.1993 117.9675 59.2780 29.9385 179.1299 78 E 3.9274 8.1129 118.2442 59.5010 29.7987 178.5165 79 D 4.6710 8.5669 116.5750 55.3339 40.7049 178.2966 80 I 3.9115 7.4286 121.2763 64.0359 37.3512 177.9589 81 A 4.0209 7.2671 120.1637 54.7690 18.4440 179.3246 82 K 3.9844 7.8886 117.7883 59.8294 32.0347 178.7449 83 E 4.2252 7.8389 118.1384 58.4252 28.3399 177.4480 84 N 4.2984 8.1515 116.1639 55.0942 39.2695 176.0146 85 E 4.3353 8.4532 121.0579 59.0004 29.8829 177.7053 86 L 3.9338 7.9449 118.6427 58.1741 41.7400 179.2376 87 R 3.9413 7.5173 117.1766 59.9607 30.0397 179.0757 88 T 3.8549 7.2921 115.1104 66.7731 68.3324 176.7807 89 K 4.3356 8.3145 120.0933 57.7459 31.6771 178.6044 90 A 4.3263 8.5104 121.1730 53.5089 18.7943 178.6203 91 E 3.9815 8.0581 116.7860 58.3128 29.6961 177.9038 92 E 3.9458 8.2096 119.1039 59.5016 29.5473 178.7924 93 E 3.9214 8.1179 117.4356 59.2299 29.8807 179.1100 94 A 3.9391 7.5248 120.5121 55.3111 18.6889 179.1266 95 D 4.3859 8.6437 116.2411 56.6113 41.2611 178.5090 96 K 4.0201 7.8439 119.2053 59.2407 31.7700 178.8997 97 L 4.5622 8.3701 122.0235 57.2250 41.8184 178.4926 98 N 4.3285 7.9117 117.0771 56.6853 39.0517 176.8649 99 K 4.3021 7.9912 118.4982 58.8019 32.2324 178.6155 100 E 4.0911 8.3621 120.4996 59.0792 29.2346 179.2464 101 V 3.6631 7.8772 111.4112 64.4919 31.8038 178.2571 102 E 4.2337 8.3480 119.1778 59.5792 29.0925 178.4561 103 D 4.4357 8.3659 117.5813 56.1991 41.3021 177.5855 104 L 4.0633 7.9962 122.7487 57.1746 42.3756 178.0433 105 T 3.8894 8.7696 116.5165 67.0896 68.5559 176.3548 106 A 4.0676 8.0416 122.3170 55.0336 18.0081 179.6409 107 S 4.6628 7.6384 113.7123 60.4538 63.2289 176.1768 108 L 3.9765 8.1239 124.5500 58.0214 41.9241 178.3018 109 F 3.9602 8.2654 120.1102 61.7845 39.1186 177.2858 110 D 4.3931 8.0848 117.7181 57.3960 40.3233 178.0307 111 E 4.2262 8.3212 116.7997 57.4265 29.7332 178.4735 112 A 4.0891 7.4485 121.4033 54.3830 19.2376 179.2422 113 N 4.0323 7.6647 114.8593 56.5656 38.5086 177.0397 114 N 4.2146 7.8743 116.9023 56.7661 39.0246 176.1008 115 L 4.1183 7.4675 121.0514 57.7142 42.0658 178.6597 116 V 3.6237 7.4240 116.0471 64.8385 31.5615 177.1446 117 A 4.1902 7.5645 118.9910 54.8075 18.7011 178.0227 118 D 4.3859 8.3362 118.1002 56.4541 41.1113 177.2153 119 A 4.1702 7.7282 122.5143 53.7160 17.6427 178.0717 120 R 4.1272 7.8458 117.0884 57.7775 30.3653 177.2490 *122 E 4.3608 8.0938 116.5087 56.2206 31.9896 177.5070 123 K 3.8661 8.1869 121.2115 60.3902 32.6308 178.2488 124 Y 4.1011 7.6755 117.0294 60.5816 38.4968 177.5989 125 A 3.9986 8.2658 121.2700 55.2391 18.3018 179.3082 126 I 3.9048 7.6029 118.2098 63.7872 37.2643 177.6782 127 E 4.1067 8.3389 117.8817 58.1489 29.3695 178.8473 128 I 3.7113 7.1490 121.0894 63.8560 37.1781 177.4551 129 L 3.9549 7.6124 119.5708 57.1905 41.8458 177.7158 130 N 4.6912 7.8479 114.6398 53.5650 39.1098 176.9168 131 K 3.8236 7.4782 122.1299 59.2765 32.3370 178.5693 132 R 3.9663 8.2978 119.0314 58.5334 29.6433 178.3022 133 L 3.9237 7.5185 119.9989 58.5588 42.2133 179.0209 134 T 3.7764 8.6148 116.5030 66.4052 68.3172 176.2454 135 E 4.2298 8.3922 120.6149 58.5321 29.6875 178.7897 136 Q 4.1409 8.5796 118.9149 58.3023 29.1786 177.5366 137 L 4.1787 9.0831 121.0472 56.6111 41.9501 178.7383 138 R 4.0754 7.1761 115.7580 59.3151 30.6492 178.1546 139 E 4.0959 8.3434 117.1742 59.0558 29.4017 179.5273 140 K 4.1207 7.8772 117.9149 59.4826 32.4777 177.3101 141 D 4.6394 7.7573 121.5421 54.5980 40.9406 176.1795 NUM RES H HA HB HB2 HB3 HD1 HD2 HD21 HD22 HD3 HE HE1 HE2 HE21 HE22 HE3 HG HG1 HG12 HG13 HG2 HG3 HZ 31 L 8.03 4.31 0.00 1.74 1.73 0.92 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 32 E 8.06 3.81 0.00 2.31 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.36 2.46 0.00 33 E 8.36 4.09 0.00 2.03 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.40 2.36 0.00 34 Q 8.18 3.96 0.00 2.14 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.10 6.72 0.00 0.00 0.00 0.00 0.00 2.33 2.40 0.00 35 L 7.97 3.92 0.00 1.79 1.84 0.92 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 36 N 8.08 4.37 0.00 2.81 2.85 0.00 0.00 6.69 6.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 37 K 7.63 3.99 0.00 1.95 1.96 0.00 1.63 0.00 0.00 1.64 0.00 0.00 2.94 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.43 1.48 7.81 38 S 8.15 4.04 0.00 4.09 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 39 L 7.99 3.97 0.00 1.76 1.86 0.92 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 40 K 7.87 4.00 0.00 2.03 1.81 0.00 1.75 0.00 0.00 1.65 0.00 0.00 2.99 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.46 1.77 7.81 41 T 7.95 3.88 4.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 42 I 8.37 3.65 1.87 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.87 0.91 0.00 0.00 43 A 8.11 4.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 44 S 8.20 4.06 0.00 4.08 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 45 Q 8.78 3.53 0.00 2.15 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.84 0.00 0.00 0.00 0.00 0.00 2.38 2.68 0.00 46 K 8.15 3.80 0.00 1.87 2.09 0.00 1.53 0.00 0.00 1.65 0.00 0.00 3.08 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.43 1.59 7.81 47 A 8.09 3.96 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 48 A 8.53 4.03 1.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 I 7.11 4.26 1.99 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 1.14 0.90 0.00 0.00 50 E 8.51 3.99 0.00 2.08 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.32 2.37 0.00 51 N 8.70 4.46 0.00 2.79 2.87 0.00 0.00 6.64 7.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 52 Y 7.88 3.92 0.00 3.07 2.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53 N 8.19 4.41 0.00 2.98 2.90 0.00 0.00 6.82 7.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54 Q 8.02 4.02 0.00 2.31 2.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.20 6.84 0.00 0.00 0.00 0.00 0.00 2.46 2.48 0.00 55 L 7.74 3.93 0.00 1.79 1.60 0.90 0.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 56 K 8.21 3.82 0.00 1.34 1.68 0.00 0.94 0.00 0.00 1.41 0.00 0.00 2.89 0.00 0.00 2.51 0.00 0.00 0.00 0.00 1.38 1.31 7.81 57 E 7.92 3.95 0.00 2.27 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.31 2.40 0.00 58 D 7.83 4.39 0.00 2.93 2.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 59 Y 8.15 3.99 0.00 3.07 2.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 60 N 8.38 4.56 0.00 2.89 2.91 0.00 0.00 7.14 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 61 T 8.10 4.01 4.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 62 L 7.32 3.95 0.00 1.70 1.57 0.84 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 63 K 7.98 3.65 0.00 1.55 1.79 0.00 1.77 0.00 0.00 1.87 0.00 0.00 3.01 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.43 1.43 7.81 64 R 7.71 3.99 0.00 2.05 2.17 0.00 2.82 0.00 0.00 3.21 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 1.65 0.00 65 E 7.63 4.91 0.00 2.01 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.44 2.38 0.00 66 L 8.42 3.95 0.00 1.71 1.74 0.88 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 67 S 7.71 4.05 0.00 3.95 4.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 68 D 7.92 4.39 0.00 2.83 2.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 69 R 7.70 3.96 0.00 1.74 1.95 0.00 3.27 0.00 0.00 3.15 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 1.78 0.00 70 D 8.46 4.46 0.00 2.64 2.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 71 D 7.99 4.43 0.00 2.98 2.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 72 E 7.59 3.88 0.00 2.26 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.30 2.31 0.00 73 V 7.72 3.55 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.04 0.00 0.00 1.00 0.00 0.00 74 K 8.01 3.69 0.00 1.95 2.01 0.00 1.75 0.00 0.00 1.64 0.00 0.00 2.95 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.47 1.79 7.81 75 R 8.33 4.12 0.00 1.93 2.01 0.00 3.13 0.00 0.00 3.16 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.82 0.00 76 L 8.05 3.95 0.00 1.84 1.71 0.92 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 77 R 8.20 3.96 0.00 2.01 1.99 0.00 3.12 0.00 0.00 3.16 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.88 0.00 78 E 8.11 3.93 0.00 2.21 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.32 2.45 0.00 79 D 8.57 4.67 0.00 2.63 2.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 80 I 7.43 3.91 2.05 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.92 0.91 0.00 0.00 81 A 7.27 4.02 1.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 82 K 7.89 3.98 0.00 1.84 1.81 0.00 1.64 0.00 0.00 1.57 0.00 0.00 2.89 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.43 1.45 7.81 83 E 7.84 4.23 0.00 2.20 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.30 2.31 0.00 84 N 8.15 4.30 0.00 3.07 2.80 0.00 0.00 6.64 7.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 85 E 8.45 4.34 0.00 2.21 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.28 2.38 0.00 86 L 7.94 3.93 0.00 1.84 1.71 0.92 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 0.00 0.00 0.00 0.00 0.00 0.00 87 R 7.52 3.94 0.00 1.64 2.01 0.00 3.29 0.00 0.00 3.16 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 1.85 0.00 88 T 7.29 3.85 4.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 89 K 8.31 4.34 0.00 1.84 1.85 0.00 1.66 0.00 0.00 1.75 0.00 0.00 2.95 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.61 1.31 7.81 90 A 8.51 4.33 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 91 E 8.06 3.98 0.00 2.25 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.27 2.53 0.00 92 E 8.21 3.95 0.00 2.18 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.33 2.56 0.00 93 E 8.12 3.92 0.00 2.07 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.31 2.33 0.00 94 A 7.52 3.94 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 95 D 8.64 4.39 0.00 2.79 2.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 96 K 7.84 4.02 0.00 2.05 1.83 0.00 1.72 0.00 0.00 1.57 0.00 0.00 2.88 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.45 1.44 7.81 97 L 8.37 4.56 0.00 1.76 1.89 0.92 0.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 98 N 7.91 4.33 0.00 3.00 2.97 0.00 0.00 7.04 6.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 99 K 7.99 4.30 0.00 1.87 1.83 0.00 1.71 0.00 0.00 1.64 0.00 0.00 2.92 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.70 1.47 7.81 100 E 8.36 4.09 0.00 2.21 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.33 2.55 0.00 101 V 7.88 3.66 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.83 0.00 0.00 1.03 0.00 0.00 102 E 8.35 4.23 0.00 2.13 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.30 2.30 0.00 103 D 8.37 4.44 0.00 2.78 2.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 104 L 8.00 4.06 0.00 1.94 1.62 0.93 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 105 T 8.77 3.89 4.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 106 A 8.04 4.07 1.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 107 S 7.64 4.66 0.00 3.95 4.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 108 L 8.12 3.98 0.00 1.79 2.03 0.96 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 109 F 8.27 3.96 0.00 3.18 3.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 110 D 8.08 4.39 0.00 2.91 2.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 111 E 8.32 4.23 0.00 2.08 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.57 2.47 0.00 112 A 7.45 4.09 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 113 N 7.66 4.03 0.00 2.77 2.74 0.00 0.00 6.60 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 114 N 7.87 4.21 0.00 2.92 2.84 0.00 0.00 7.30 7.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 115 L 7.47 4.12 0.00 1.94 1.77 0.90 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 116 V 7.42 3.62 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.84 0.00 0.00 0.91 0.00 0.00 117 A 7.56 4.19 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 118 D 8.34 4.39 0.00 2.75 2.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 119 A 7.73 4.17 1.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 120 R 7.85 4.13 0.00 2.16 2.03 0.00 3.16 0.00 0.00 3.14 7.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.67 0.00 *122 E 8.09 4.36 0.00 2.13 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.42 2.42 0.00 123 K 8.19 3.87 0.00 1.87 1.94 0.00 1.94 0.00 0.00 1.65 0.00 0.00 2.95 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.47 1.55 7.81 124 Y 7.68 4.10 0.00 3.03 2.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 125 A 8.27 4.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 126 I 7.60 3.90 2.02 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.38 0.89 0.00 0.00 127 E 8.34 4.11 0.00 2.06 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.86 0.00 128 I 7.15 3.71 1.92 0.00 0.00 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.05 0.50 0.83 0.00 0.00 129 L 7.61 3.95 0.00 1.76 1.76 0.90 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 130 N 7.85 4.69 0.00 2.70 2.79 0.00 0.00 6.49 8.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 131 K 7.48 3.82 0.00 1.90 1.77 0.00 1.51 0.00 0.00 1.52 0.00 0.00 2.87 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.46 1.41 7.81 132 R 8.30 3.97 0.00 2.02 1.88 0.00 3.12 0.00 0.00 3.08 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.61 0.00 133 L 7.52 3.92 0.00 1.80 1.74 0.91 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 134 T 8.61 3.78 4.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 135 E 8.39 4.23 0.00 2.05 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.29 2.42 0.00 136 Q 8.58 4.14 0.00 2.21 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.09 6.85 0.00 0.00 0.00 0.00 0.00 2.35 2.48 0.00 137 L 9.08 4.18 0.00 1.69 1.65 0.91 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 138 R 7.18 4.08 0.00 1.97 1.95 0.00 3.26 0.00 0.00 3.22 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.79 0.00 139 E 8.34 4.10 0.00 2.02 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.34 2.51 0.00 140 K 7.88 4.12 0.00 1.77 1.85 0.00 1.69 0.00 0.00 1.70 0.00 0.00 3.02 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.47 1.69 7.81 141 D 7.76 4.64 0.00 2.76 2.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.